Home Other Building Blocks 3-Bromo-5-(trifluoromethyl)phenylacetic acid

3-Bromo-5-(trifluoromethyl)phenylacetic acid

CAS No.:
1161362-01-1
Catalog Number:
AG000BPA
Molecular Formula:
C9H6BrF3O2
Molecular Weight:
283.0419
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$93
- +
5g
95%
In Stock USA
United States
$239
- +
25g
95%
In Stock USA
United States
$678
- +
Product Description
Catalog Number:
AG000BPA
Chemical Name:
3-Bromo-5-(trifluoromethyl)phenylacetic acid
CAS Number:
1161362-01-1
Molecular Formula:
C9H6BrF3O2
Molecular Weight:
283.0419
MDL Number:
MFCD13194218
IUPAC Name:
2-[3-bromo-5-(trifluoromethyl)phenyl]acetic acid
InChI:
InChI=1S/C9H6BrF3O2/c10-7-2-5(3-8(14)15)1-6(4-7)9(11,12)13/h1-2,4H,3H2,(H,14,15)
InChI Key:
POLZAYSCKXDHKM-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc(Br)cc(c1)C(F)(F)F
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.95g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.044g/mol
Monoisotopic Mass:
281.95g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties